4025-0040 Screening compound: 4-cyano-2-fluoro-N-(4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)benzamide

4025-0040 Screening compound: 4-cyano-2-fluoro-N-(4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)benzamide
4025-0040 Screening compound: 4-cyano-2-fluoro-N-(4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4025-0040
4-cyano-2-fluoro-N-(4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)benzamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

4025-0040

Molecular Formula

C20H11FN4O2 (C20 H11 FN4 O2)

Compound Name

4-cyano-2-fluoro-N-(4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)benzamide

IUPAC name

4-cyano-2-fluoro-N-(4-{[13]oxazolo[45-b]pyridin-2-yl}phenyl)benzamide

SMILES

N#Cc(cc1)cc(F)c1C(Nc(cc1)ccc1-c1nc(nccc2)c2o1)=O

InChI

InChI=1S/C20H11FN4O2/c21-16-10-12(11-22)3-8-15(16)19(26)24-14-6-4-13(5-7-14)20-25-18-17(27-20)2-1-9-23-18/h1-10H,(H,24,26)

InChI Key

GMTNKHWPNXWXMY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03031428

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.625

Distribution Coefficient, logD

3.624

Water Solubility, LogSw

-4.18

Polar Surface Area

67.570

Acid Dissociation Constant (pKa)

10.10

Base Dissociation Constant (pKb)

1.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

4025-0040 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Cardiovascular Library (22201 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cardiovascular
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4025-0040 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4025-0040?
Check Price and Availability of 4025-0040, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4025-0040 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4025-0040
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4025-0040
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 4025-0040 available by request